CID 9557969

303065-96-5

Structural Information

Molecular Formula
C21H18N2O2
SMILES
C1=CC=C(C=C1)/C=N/NC(=O)COC2=CC=C(C=C2)C3=CC=CC=C3
InChI
InChI=1S/C21H18N2O2/c24-21(23-22-15-17-7-3-1-4-8-17)16-25-20-13-11-19(12-14-20)18-9-5-2-6-10-18/h1-15H,16H2,(H,23,24)/b22-15+
InChIKey
QJWICUBVIWALQJ-PXLXIMEGSA-N
Compound name
N-[(E)-benzylideneamino]-2-(4-phenylphenoxy)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

330.13684 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 331.14412 178.1
[M+Na]+ 353.12606 182.7
[M-H]- 329.12956 188.3
[M+NH4]+ 348.17066 190.8
[M+K]+ 369.10000 177.8
[M+H-H2O]+ 313.13410 167.5
[M+HCOO]- 375.13504 204.6
[M+CH3COO]- 389.15069 214.5
[M+Na-2H]- 351.11151 184.2
[M]+ 330.13629 178.2
[M]- 330.13739 178.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.